Sc. Hwang et R. Waser, Study of electrical and mechanical contribution to switching in ferroelectric/ferroelastic polycrystals, ACT MATER, 48(12), 2000, pp. 3271-3282
Polarization switching in a polycrystalline ferroelectric/ferroelastic cera
mic is simulated with a finite element model. It is assumed that a crystall
ite switches if the reduction in potential energy of the polycrystal exceed
s a critical energy barrier per unit volume of switching material. Each cry
stallite, represented by a cubic element in a finite element mesh, is a sin
gle domain that switches completely without a simulated domain wall motion.
The possible dipole directions of each crystallite are assigned randomly s
ubject to crystallographic constraints. The model accounts for electric fie
ld induced (i.e. ferroelectric) switching and stress induced (i.e, ferroela
stic) switching without piezoelectric interaction. Different weights for th
e mechanical and electrical contribution to switching are selected phenomen
ologically to simulate electric displacement vs electric field and strain v
s electric field of a ceramic lead lanthanum zirconate titanate (PLZT). Alt
hough the critical energy barriers for 90 degrees and 180 degrees switching
are assumed to be the same, 90 degrees switching is favored when the elect
rical contribution to switching (i.e. electrical energy) is dominant, but 1
80 degrees switching is favored when the mechanical contribution to switchi
ng (i.e. elastic strain energy) is dominant. With increasing mechanical con
tribution and decreasing electrical contribution, the simulated electric di
splacement deviates from the Rayleigh law under a low applied electric fiel
d, and the shape of a switching region (or a process zone) changes from a p
rolonged ellipsoid to a sphere. (C) 2000 Published by Elsevier Science Ltd
on behalf of Acta Metallurgica Inc.